2-[(2-chlorophenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-chlorobenzyl)thio]-6-phenyl-1H-pyrimidin-4-one Formula: C17H13ClN2OS MolecularWeight: 328.81592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C17H13ClN2OS/c18-14-9-5-4-8-13(14)11-22-17-19-15(10-16(21)20-17)12-6-2-1-3-7-12/h1-10H,11H2,(H,19,20,21)